| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 20 | Yes |
Popular Name: 2-[(2S)-1-[(1-isopropylpyrazol-3-yl)methyl]-3-oxo-piperazin-2-yl]acetic 2-[(2S)-1-[(1-isopropylpyrazol-3…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | -0.36 | 4.73 | -42.43 | 2 | 7 | 0 | 91 | 280.328 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.36 | 3.56 | -54.57 | 1 | 7 | -1 | 90 | 279.32 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
